N-[4-[bis(imidazo[1,2-a]pyridin-2-ylmethyl)amino]phenyl]acetamide

C24H22N6O — CID 3400889

IUPACN-[4-[bis(imidazo[1,2-a]pyridin-2-ylmethyl)amino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(N(Cc2cn3ccccc3n2)Cc2cn3ccccc3n2)cc1
InChIInChI=1S/C24H22N6O/c1-18(31)25-19-8-10-22(11-9-19)30(16-20-14-28-12-4-2-6-23(28)26-20)17-21-15-29-13-5-3-7-24(29)27-21/h2-15H,16-17H2,1H3,(H,25,31)
InChIKeyDOWLABOVTBFOPK-UHFFFAOYSA-N
MW410.48 g/mol
LogP4.15
Rot. Bonds6

About N-[4-[bis(imidazo[1,2-a]pyridin-2-ylmethyl)amino]phenyl]acetamide

N-[4-[bis(imidazo[1,2-a]pyridin-2-ylmethyl)amino]phenyl]acetamide (PubChem CID 3400889) has the molecular formula C24H22N6O and a molecular weight of 410.48 g/mol. Its IUPAC name is N-[4-[bis(imidazo[1,2-a]pyridin-2-ylmethyl)amino]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[bis(imidazo[1,2-a]pyridin-2-ylmethyl)amino]phenyl]acetamide
PubChem CID3400889
Molecular FormulaC24H22N6O
Molecular Weight410.48 g/mol
Exact Mass410.19
IUPAC NameN-[4-[bis(imidazo[1,2-a]pyridin-2-ylmethyl)amino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(N(Cc2cn3ccccc3n2)Cc2cn3ccccc3n2)cc1
InChIInChI=1S/C24H22N6O/c1-18(31)25-19-8-10-22(11-9-19)30(16-20-14-28-12-4-2-6-23(28)26-20)17-21-15-29-13-5-3-7-24(29)27-21/h2-15H,16-17H2,1H3,(H,25,31)
InChIKeyDOWLABOVTBFOPK-UHFFFAOYSA-N
XLogP4.15
TPSA66.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.48
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Analyze N-[4-[bis(imidazo[1,2-a]pyridin-2-ylmethyl)amino]phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[4-[bis(imidazo[1,2-a]pyridin-2-ylmethyl)amino]phenyl]acetamide?
The IUPAC name of N-[4-[bis(imidazo[1,2-a]pyridin-2-ylmethyl)amino]phenyl]acetamide (CID 3400889) is N-[4-[bis(imidazo[1,2-a]pyridin-2-ylmethyl)amino]phenyl]acetamide.
What is the SMILES notation for N-[4-[bis(imidazo[1,2-a]pyridin-2-ylmethyl)amino]phenyl]acetamide?
The canonical SMILES for N-[4-[bis(imidazo[1,2-a]pyridin-2-ylmethyl)amino]phenyl]acetamide is CC(=O)Nc1ccc(N(Cc2cn3ccccc3n2)Cc2cn3ccccc3n2)cc1.
What is the InChIKey of N-[4-[bis(imidazo[1,2-a]pyridin-2-ylmethyl)amino]phenyl]acetamide?
The InChIKey is DOWLABOVTBFOPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N6O/c1-18(31)25-19-8-10-22(11-9-19)30(16-20-14-28-12-4-2-6-23(28)26-20)17-21-15-29-13-5-3-7-24(29)27-21/h2-15H,16-17H2,1H3,(H,25,31).
What are the key properties of N-[4-[bis(imidazo[1,2-a]pyridin-2-ylmethyl)amino]phenyl]acetamide?
N-[4-[bis(imidazo[1,2-a]pyridin-2-ylmethyl)amino]phenyl]acetamide has a molecular weight of 410.48 g/mol, XLogP of 4.15, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[bis(imidazo[1,2-a]pyridin-2-ylmethyl)amino]phenyl]acetamide is sourced from PubChem (CID 3400889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).